Sentence examples for molecular descriptors from inspiring English sources

Molecular descriptors.

The full list of the molecular descriptors.

The sequential search algorithm was implemented to select the optimal subset of molecular descriptors containing temperature, 4 anion-based molecular descriptors, and 5 cation-based molecular descriptors.

For an extensive reference on molecular descriptors, cf. [10].

Principal components analysis to reduce the number of molecular descriptors.

It can calculate only 307 small molecular descriptors.

Topological indices are extensively used in chemistry as molecular descriptors.

where l is the number of molecular descriptors.

Molecular descriptors are computed and scored on the fly.

DFT calculations were first performed to obtain quantum molecular descriptors.

Many different molecular descriptors are in common use.